7-(3-Bromo-4-methylphenyl)-7-oxoheptanoic acid
[CAS# 898767-22-1]

Identification

• Name: 7-(3-Bromo-4-methylphenyl)-7-oxoheptanoic acid
• Synonyms: 7-(3-bromo-4-methylphenyl)-7-oxoheptanoic acid
• Molecular Formula: C₁₄H₁₇BrO₃
• Molecular Weight: 313.19
• CAS Registry Number: 898767-22-1
• SMILES: Cc1ccc(cc1Br)C(=O)CCCCCC(O)=O
• InChI: 1S/C14H17BrO3/c1-10-7-8-11(9-12(10)15)13(16)5-3-2-4-6-14(17)18/h7-9H,2-6H2,1H3,(H,17,18)
• InChIKey: WNACFNCYKMKAKX-UHFFFAOYSA-N

Properties

• Density: 1.358g/cm³ (Cal.)
• Boiling point: 468.13°C at 760 mmHg (Cal.)
• Flash point: 236.917°C (Cal.)
• Refractive index: 1.55 (Cal.)